#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a5w s GLU 3 N 0.00 2.93 -0.16 0.54 2.02 -1.26 -0.58 118.70 122.18 2a5w s GLU 3 Ca 0.00 -1.15 -0.02 0.00 0.02 0.00 0.00 54.97 53.82 2a5w s GLU 3 Cb 0.00 -2.65 0.05 0.00 0.10 0.00 0.00 34.13 31.63 2a5w s GLU 3 CO 0.00 0.09 0.02 -1.17 0.02 0.00 0.00 175.26 174.23 2a5w s LEU 4 N -4.08 1.02 -0.19 1.80 2.96 -0.13 -4.86 118.68 115.20 2a5w s LEU 4 Ca 0.43 -0.62 -0.28 0.00 -0.22 0.00 0.00 54.13 53.43 2a5w s LEU 4 Cb -0.08 -0.56 0.00 0.00 0.50 0.00 0.00 46.19 46.05 2a5w s LEU 4 CO 0.29 -0.27 0.99 -1.61 -1.32 0.00 0.00 176.35 174.42 2a5w s GLU 5 N 1.88 4.30 -0.24 1.98 2.02 -1.26 -1.09 118.70 126.29 2a5w s GLU 5 Ca 0.01 1.29 -0.25 0.00 0.02 0.00 0.00 54.97 56.04 2a5w s GLU 5 Cb -0.16 -3.61 0.07 0.00 0.10 0.00 0.00 34.13 30.53 2a5w s GLU 5 CO -0.07 -0.51 0.69 0.54 0.02 0.00 0.00 175.26 175.92 2a5w s VAL 6 N 2.76 0.00 -1.44 2.63 0.11 -0.79 -5.01 120.40 118.67 2a5w s VAL 6 Ca 0.44 -0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.42 2a5w s VAL 6 Cb -0.16 -0.96 0.04 0.00 -1.53 0.00 0.00 36.38 33.77 2a5w s VAL 6 CO 0.10 -0.00 0.69 2.29 -3.33 0.00 0.00 175.10 174.84 2a5w n LYS 7 N 2.54 -4.32 -1.02 1.54 2.85 -1.26 -1.45 118.16 117.03 2a5w n LYS 7 Ca -0.14 0.51 -0.01 0.00 -1.05 0.00 0.00 58.31 57.62 2a5w n LYS 7 Cb 0.55 -5.03 -0.00 0.00 -0.65 0.00 0.00 35.03 29.90 2a5w n LYS 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2a5w n GLY 8 N -1.71 0.25 3.37 2.58 0.00 -1.26 -4.98 105.19 103.43 2a5w n GLY 8 Ca -0.17 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2a5w n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a5w s LYS 9 N -1.36 1.38 -0.34 1.61 1.02 -0.53 -5.12 119.74 116.40 2a5w s LYS 9 Ca 0.00 -1.45 -0.03 0.00 0.02 0.00 0.00 55.97 54.51 2a5w s LYS 9 Cb 0.00 -1.57 0.06 0.00 -0.52 0.00 0.00 37.83 35.80 2a5w s LYS 9 CO 0.00 0.33 0.08 0.15 -0.92 0.00 0.00 175.35 174.99 2a5w s LYS 10 N -2.68 2.36 0.05 1.68 1.02 -1.26 -1.88 119.74 119.04 2a5w s LYS 10 Ca 0.17 -1.39 -0.11 0.00 0.02 0.00 0.00 55.97 54.66 2a5w s LYS 10 Cb -0.07 -3.36 -0.06 0.00 -0.52 0.00 0.00 37.83 33.82 2a5w s LYS 10 CO 0.08 -0.75 0.39 -0.51 -0.92 0.00 0.00 175.35 173.64 2a5w s LEU 11 N 1.26 4.39 -0.11 3.17 1.43 -0.25 -4.88 118.68 123.68 2a5w s LEU 11 Ca -0.01 0.83 -0.26 0.00 -1.03 0.00 0.00 54.13 53.66 2a5w s LEU 11 Cb -0.21 -2.84 -0.02 0.00 0.03 0.00 0.00 46.19 43.16 2a5w s LEU 11 CO -0.01 0.22 0.83 -0.60 0.23 0.00 0.00 176.35 177.03 2a5w s ARG 12 N -1.64 4.38 0.15 1.70 3.52 -1.26 -0.95 118.95 124.84 2a5w s ARG 12 Ca 0.30 1.07 0.07 0.00 -0.13 0.00 0.00 55.73 57.04 2a5w s ARG 12 Cb -0.15 -3.52 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2a5w s ARG 12 CO 0.16 -0.18 0.01 -0.51 -0.81 0.00 0.00 175.30 173.96 2a5w s LEU 13 N 1.62 3.37 0.00 -0.88 1.43 0.25 -0.83 118.68 123.64 2a5w s LEU 13 Ca 0.41 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 53.11 2a5w s LEU 13 Cb -0.18 -2.05 0.11 0.00 0.03 0.00 0.00 46.19 44.10 2a5w s LEU 13 CO 0.17 0.11 0.65 -0.90 0.23 0.00 0.00 176.35 176.61 2a5w n ASP 14 N 0.07 0.12 0.11 2.29 5.68 -0.26 -2.25 116.55 122.31 2a5w n ASP 14 Ca -0.10 -1.28 0.11 0.00 -0.50 0.00 0.00 54.79 53.02 2a5w n ASP 14 Cb 0.54 -0.49 0.46 0.00 -1.14 0.00 0.00 41.12 40.50 2a5w n ASP 14 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2a5w n GLU 15 N -2.35 0.15 -0.15 0.11 -0.58 -1.26 -1.72 120.64 114.84 2a5w n GLU 15 Ca 0.08 0.44 0.08 0.00 -0.42 0.00 0.00 57.16 57.34 2a5w n GLU 15 Cb 0.29 -1.82 0.15 0.00 -0.57 0.00 0.00 31.44 29.49 2a5w n GLU 15 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2a5w n ASP 16 N -2.11 2.90 0.00 1.62 8.00 -1.26 -4.98 116.55 120.72 2a5w n ASP 16 Ca 0.02 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.66 2a5w n ASP 16 Cb 0.18 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 2a5w n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a5w n GLY 17 N 0.90 0.61 3.77 0.44 0.00 -0.70 -4.97 105.19 105.24 2a5w n GLY 17 Ca 0.13 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 2a5w n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2a5w s PHE 18 N -2.00 3.76 -0.26 1.61 0.40 -1.26 -4.78 117.98 115.45 2a5w s PHE 18 Ca 0.00 1.40 -0.28 0.00 -0.60 0.00 0.00 56.93 57.44 2a5w s PHE 18 Cb 0.00 -2.70 -0.03 0.00 0.51 0.00 0.00 43.02 40.79 2a5w s PHE 18 CO 0.00 0.39 1.90 -1.17 0.70 0.00 0.00 175.22 177.04 2a5w s LEU 19 N -0.45 3.59 0.05 -0.37 2.96 -1.25 -1.10 118.68 122.10 2a5w s LEU 19 Ca 0.34 1.59 0.00 0.00 -0.22 0.00 0.00 54.13 55.84 2a5w s LEU 19 Cb -0.20 -3.52 -0.26 0.00 0.50 0.00 0.00 46.19 42.71 2a5w s LEU 19 CO 0.21 -1.68 1.03 1.56 -1.32 0.00 0.00 176.35 176.15 2a5w h GLN 20 N 13.07 0.18 -2.63 1.98 1.08 -1.28 -3.23 115.11 124.27 2a5w h GLN 20 Ca -0.37 -0.31 -0.50 0.00 -1.45 0.00 0.00 58.65 56.03 2a5w h GLN 20 Cb 1.19 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.73 2a5w h GLN 20 CO 1.00 1.07 2.32 -0.25 -0.95 0.00 0.00 178.83 182.02 2a5w n ASP 21 N -3.42 7.51 0.27 1.46 8.00 -1.23 -4.75 116.55 124.39 2a5w n ASP 21 Ca -0.10 -2.55 0.16 0.00 0.71 0.00 0.00 54.79 53.01 2a5w n ASP 21 Cb 1.01 -1.51 0.89 0.00 -0.02 0.00 0.00 41.12 41.50 2a5w n ASP 21 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 2a5w h TRP 22 N 4.27 0.00 0.00 1.24 5.08 -1.81 0.57 115.95 125.30 2a5w h TRP 22 Ca 0.63 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.60 2a5w h TRP 22 Cb 0.72 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.88 2a5w h TRP 22 CO 1.85 0.00 0.00 0.39 -1.28 0.00 0.00 178.44 179.40 2a5w n GLU 23 N -3.83 0.86 0.00 0.12 1.02 -1.26 -2.79 120.64 114.76 2a5w n GLU 23 Ca -0.02 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.25 2a5w n GLU 23 Cb 0.15 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.35 2a5w n GLU 23 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2a5w n GLU 24 N -1.05 1.03 -1.99 3.49 -0.58 0.19 -4.97 120.64 116.76 2a5w n GLU 24 Ca 0.21 -0.69 -0.39 0.00 -0.42 0.00 0.00 57.16 55.87 2a5w n GLU 24 Cb 0.13 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 2a5w n GLU 24 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 2a5w s TRP 25 N -2.45 2.70 0.25 -0.32 -0.00 -1.12 -4.92 118.94 113.08 2a5w s TRP 25 Ca 0.24 1.38 -0.06 0.00 -0.00 0.00 0.00 56.10 57.66 2a5w s TRP 25 Cb 0.19 -3.71 0.03 0.00 -0.00 0.00 0.00 33.47 29.97 2a5w s TRP 25 CO 0.52 -2.30 0.44 -0.40 -0.00 0.00 0.00 176.95 175.21 2a5w n ASP 26 N -0.09 -1.26 -0.31 5.86 5.68 -1.26 -5.00 116.55 120.17 2a5w n ASP 26 Ca 0.05 -2.13 0.11 0.00 -0.50 0.00 0.00 54.79 52.31 2a5w n ASP 26 Cb 0.44 2.17 0.33 0.00 -1.14 0.00 0.00 41.12 42.92 2a5w n ASP 26 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2a5w h GLU 27 N 0.00 0.77 -0.09 0.11 5.08 -1.99 0.25 114.58 118.72 2a5w h GLU 27 Ca -0.20 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2a5w h GLU 27 Cb 0.80 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 2a5w h GLU 27 CO 0.26 0.51 0.04 0.93 -1.00 0.00 0.00 179.01 179.75 2a5w h GLU 28 N 0.79 0.12 -0.62 2.33 5.08 -1.98 -1.45 114.58 118.85 2a5w h GLU 28 Ca 0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 2a5w h GLU 28 Cb 0.68 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 2a5w h GLU 28 CO -0.24 0.21 0.39 0.28 -1.00 0.00 0.00 179.01 178.65 2a5w h VAL 29 N 0.01 1.17 -0.78 3.13 2.07 -1.77 -1.60 116.25 118.47 2a5w h VAL 29 Ca 0.03 -0.35 0.10 0.00 0.82 0.00 0.00 66.70 67.30 2a5w h VAL 29 Cb 0.13 0.29 -0.07 0.00 -1.52 0.00 0.00 31.29 30.11 2a5w h VAL 29 CO -0.00 0.17 0.42 0.00 0.02 0.00 0.00 177.57 178.18 2a5w h ALA 30 N 1.21 1.11 -0.62 1.67 0.00 -0.73 0.25 119.26 122.15 2a5w h ALA 30 Ca 0.23 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2a5w h ALA 30 Cb -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2a5w h ALA 30 CO -0.05 0.02 0.11 1.49 0.00 0.00 0.00 179.25 180.83 2a5w h GLU 31 N 0.70 1.01 -0.43 0.00 4.57 -0.69 0.59 114.58 120.34 2a5w h GLU 31 Ca 0.39 -0.26 -0.08 0.00 -1.18 0.00 0.00 59.36 58.22 2a5w h GLU 31 Cb 0.39 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.85 2a5w h GLU 31 CO -0.27 0.94 -0.04 0.00 -1.18 0.00 0.00 179.01 178.47 2a5w h ALA 32 N 1.03 0.58 -0.61 2.92 0.00 -0.59 -2.47 119.26 120.12 2a5w h ALA 32 Ca 0.19 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2a5w h ALA 32 Cb 0.41 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2a5w h ALA 32 CO 0.01 0.40 0.40 -0.07 0.00 0.00 0.00 179.25 179.99 2a5w h LEU 33 N 0.61 0.70 -1.63 0.00 3.38 -0.71 -2.05 115.31 115.61 2a5w h LEU 33 Ca 0.12 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2a5w h LEU 33 Cb 0.54 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2a5w h LEU 33 CO 0.03 0.51 0.26 0.00 0.09 0.00 0.00 178.44 179.33 2a5w h ALA 34 N 1.22 1.74 -0.39 1.53 0.00 -0.67 -1.89 119.26 120.80 2a5w h ALA 34 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2a5w h ALA 34 Cb -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2a5w h ALA 34 CO -0.05 0.23 0.00 0.36 0.00 0.00 0.00 179.25 179.79 2a5w n LYS 35 N -4.48 2.16 -2.44 0.00 2.85 -0.95 -1.09 118.16 114.22 2a5w n LYS 35 Ca 0.03 -1.78 -0.38 0.00 -1.05 0.00 0.00 58.31 55.13 2a5w n LYS 35 Cb 0.08 -1.43 -0.03 0.00 -0.65 0.00 0.00 35.03 32.99 2a5w n LYS 35 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2a5w s ASP 36 N -1.28 6.12 0.00 -5.58 -1.08 -0.71 -4.71 116.67 109.43 2a5w s ASP 36 Ca 0.35 -1.00 0.15 0.00 -0.52 0.00 0.00 52.55 51.53 2a5w s ASP 36 Cb 0.19 -2.56 0.87 0.00 -1.46 0.00 0.00 42.92 39.96 2a5w s ASP 36 CO 0.27 -1.84 1.55 0.35 0.52 0.00 0.00 175.17 176.01 2a5w n THR 37 N 6.97 0.00 0.25 1.71 -2.24 -1.26 -2.25 114.28 117.45 2a5w n THR 37 Ca 0.27 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.19 2a5w n THR 37 Cb 0.50 -0.24 0.56 0.00 -2.10 0.00 0.00 70.33 69.04 2a5w n THR 37 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2a5w h ARG 38 N 0.00 0.00 0.00 -0.78 3.08 -1.97 -3.34 114.38 111.37 2a5w h ARG 38 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2a5w h ARG 38 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2a5w h ARG 38 CO 0.00 0.10 0.00 1.19 -1.07 0.00 0.00 179.97 180.19 2a5w n PHE 39 N -3.23 0.00 -3.73 3.04 3.01 -0.96 -5.01 117.46 110.59 2a5w n PHE 39 Ca 0.01 -0.22 -0.12 0.00 1.01 0.00 0.00 57.45 58.13 2a5w n PHE 39 Cb 0.37 -0.02 -0.12 0.00 -0.01 0.00 0.00 39.48 39.70 2a5w n PHE 39 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2a5w s SER 40 N -0.43 -0.36 0.22 4.37 0.15 -1.17 -4.98 113.70 111.51 2a5w s SER 40 Ca 0.00 0.66 -0.08 0.00 0.70 0.00 0.00 55.95 57.23 2a5w s SER 40 Cb 0.00 0.57 0.36 0.00 -1.71 0.00 0.00 66.02 65.24 2a5w s SER 40 CO 0.00 -0.16 1.69 -0.65 1.20 0.00 0.00 173.24 175.32 2a5w h PRO 41 N 6.87 0.25 -4.71 5.44 0.11 -1.91 -3.39 132.00 134.65 2a5w h PRO 41 Ca -0.37 -0.01 -0.28 0.00 0.11 0.00 0.00 66.00 65.45 2a5w h PRO 41 Cb 1.17 -0.06 -0.20 0.00 0.11 0.00 0.00 31.00 32.03 2a5w h PRO 41 CO 0.34 0.16 -0.73 -0.65 -0.21 0.00 0.00 178.00 176.91 2a5w s GLN 42 N -6.09 0.65 0.62 1.05 -1.52 -1.26 -4.99 119.66 108.12 2a5w s GLN 42 Ca -0.13 -0.93 -0.18 0.00 -1.95 0.00 0.00 55.36 52.17 2a5w s GLN 42 Cb 0.19 -0.36 -0.04 0.00 -0.22 0.00 0.00 33.01 32.58 2a5w s GLN 42 CO 0.75 0.06 0.97 -0.35 -0.25 0.00 0.00 175.29 176.46 2a5w n PRO 43 N 1.07 0.86 -3.90 2.91 -0.04 -1.26 -4.92 135.00 129.71 2a5w n PRO 43 Ca -0.20 0.34 -0.35 0.00 -0.04 0.00 0.00 63.50 63.24 2a5w n PRO 43 Cb 0.56 -2.18 -0.13 0.00 -0.04 0.00 0.00 33.50 31.71 2a5w n PRO 43 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2a5w s ILE 44 N -1.53 3.77 -0.27 0.52 1.01 -0.25 -4.99 121.20 119.47 2a5w s ILE 44 Ca 0.77 -0.36 -0.29 0.00 0.00 0.00 0.00 60.65 60.77 2a5w s ILE 44 Cb -0.41 -2.73 -0.00 0.00 0.01 0.00 0.00 42.46 39.33 2a5w s ILE 44 CO 0.46 0.40 1.31 -0.70 0.00 0.00 0.00 174.94 176.41 2a5w s GLU 45 N 1.42 3.97 -0.66 2.79 2.12 -1.26 -4.64 118.70 122.44 2a5w s GLU 45 Ca 0.05 1.34 -0.26 0.00 0.36 0.00 0.00 54.97 56.46 2a5w s GLU 45 Cb -0.15 -3.86 0.04 0.00 0.26 0.00 0.00 34.13 30.42 2a5w s GLU 45 CO -0.00 -1.05 1.15 -0.51 -0.54 0.00 0.00 175.26 174.31 2a5w s LEU 46 N 4.25 3.60 0.85 2.70 1.43 -1.26 -4.98 118.68 125.28 2a5w s LEU 46 Ca 0.57 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 53.11 2a5w s LEU 46 Cb -0.18 -2.70 0.13 0.00 0.03 0.00 0.00 46.19 43.47 2a5w s LEU 46 CO 0.22 -1.60 1.21 0.42 0.23 0.00 0.00 176.35 176.83 2a5w s THR 47 N 4.99 2.03 0.38 5.49 -4.23 -1.26 -4.86 115.64 118.18 2a5w s THR 47 Ca 0.33 -0.05 0.05 0.00 -1.18 0.00 0.00 61.69 60.85 2a5w s THR 47 Cb -0.10 -2.98 0.25 0.00 1.34 0.00 0.00 72.50 71.00 2a5w s THR 47 CO 0.17 0.00 2.02 -0.08 -0.54 0.00 0.00 174.62 176.19 2a5w h GLU 48 N -1.22 0.62 -0.45 3.99 4.57 -1.99 -1.34 114.58 118.76 2a5w h GLU 48 Ca -0.45 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 57.71 2a5w h GLU 48 Cb 1.29 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 29.71 2a5w h GLU 48 CO 0.54 0.44 0.26 0.93 -1.18 0.00 0.00 179.01 180.00 2a5w h GLU 49 N 0.63 0.50 -0.33 1.92 5.08 -1.99 0.12 114.58 120.51 2a5w h GLU 49 Ca 0.17 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.54 2a5w h GLU 49 Cb -0.02 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 2a5w h GLU 49 CO -0.03 0.33 0.09 0.45 -1.00 0.00 0.00 179.01 178.85 2a5w h HIS 50 N 0.52 0.15 -0.82 4.33 3.86 -1.64 -2.40 115.15 119.15 2a5w h HIS 50 Ca 0.18 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 2a5w h HIS 50 Cb 0.03 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 2a5w h HIS 50 CO -0.08 0.05 0.54 -1.49 0.86 0.00 0.00 177.93 177.81 2a5w h TRP 51 N 0.21 1.02 -0.64 2.45 4.06 -0.86 0.12 115.95 122.32 2a5w h TRP 51 Ca 0.16 0.02 -0.05 0.00 2.06 0.00 0.00 58.89 61.08 2a5w h TRP 51 Cb 0.15 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 27.94 2a5w h TRP 51 CO -0.16 0.64 0.21 0.87 -3.56 0.00 0.00 178.44 176.43 2a5w h LYS 52 N 1.10 0.99 -0.10 0.49 1.57 -0.71 0.15 116.57 120.07 2a5w h LYS 52 Ca 0.30 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2a5w h LYS 52 Cb -0.12 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.04 2a5w h LYS 52 CO -0.07 0.87 -0.02 0.82 -0.57 0.00 0.00 179.45 180.48 2a5w h ILE 53 N 0.92 1.28 -0.39 1.86 2.04 -0.92 -2.33 117.51 119.98 2a5w h ILE 53 Ca 0.21 -0.91 0.07 0.00 1.00 0.00 0.00 64.86 65.22 2a5w h ILE 53 Cb 0.28 1.69 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2a5w h ILE 53 CO -0.01 0.26 0.02 0.40 0.00 0.00 0.00 178.15 178.82 2a5w h ILE 54 N -0.13 0.73 -0.58 -0.67 2.04 -0.64 -1.63 117.51 116.64 2a5w h ILE 54 Ca 0.03 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 2a5w h ILE 54 Cb 0.41 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2a5w h ILE 54 CO 0.01 0.02 0.20 0.03 0.00 0.00 0.00 178.15 178.41 2a5w h ARG 55 N 0.13 0.89 -0.07 2.37 3.08 -0.99 -1.87 114.38 117.91 2a5w h ARG 55 Ca 0.19 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 60.08 2a5w h ARG 55 Cb 0.26 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2a5w h ARG 55 CO -0.30 0.79 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.39 2a5w h TYR 56 N 0.81 -0.20 -0.46 3.04 3.20 -1.15 -0.35 116.97 121.86 2a5w h TYR 56 Ca 0.19 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 2a5w h TYR 56 Cb 0.26 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2a5w h TYR 56 CO 0.02 -0.13 0.28 -0.07 -1.64 0.00 0.00 178.16 176.62 2a5w h LEU 57 N -0.11 0.45 -0.39 2.82 3.38 -1.21 -1.39 115.31 118.87 2a5w h LEU 57 Ca 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 2a5w h LEU 57 Cb 0.19 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2a5w h LEU 57 CO -0.14 0.32 -0.13 -0.09 0.09 0.00 0.00 178.44 178.50 2a5w h ARG 58 N 0.56 0.77 -0.72 1.13 2.43 -1.24 -1.53 114.38 115.78 2a5w h ARG 58 Ca 0.18 -0.31 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 2a5w h ARG 58 Cb 0.00 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.47 2a5w h ARG 58 CO -0.08 0.92 0.44 -0.44 -1.51 0.00 0.00 179.97 179.31 2a5w h ASP 59 N 0.58 0.72 -0.24 -3.80 3.32 -0.96 -0.94 116.42 115.10 2a5w h ASP 59 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2a5w h ASP 59 Cb 0.66 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 2a5w h ASP 59 CO 0.04 0.49 0.15 0.22 -1.72 0.00 0.00 179.24 178.43 2a5w h TYR 60 N 0.86 0.30 -0.69 4.55 3.20 -1.07 -1.44 116.97 122.69 2a5w h TYR 60 Ca 0.30 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 2a5w h TYR 60 Cb 0.05 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 2a5w h TYR 60 CO -0.04 0.20 0.39 0.35 -1.64 0.00 0.00 178.16 177.42 2a5w h PHE 61 N 0.32 0.93 -0.84 -3.82 3.57 -1.01 0.27 116.94 116.35 2a5w h PHE 61 Ca 0.09 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2a5w h PHE 61 Cb -0.02 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.38 2a5w h PHE 61 CO -0.06 0.65 0.42 0.82 -2.23 0.00 0.00 178.31 177.92 2a5w h ILE 62 N 0.94 1.26 -0.01 1.41 2.04 -1.04 0.36 117.51 122.46 2a5w h ILE 62 Ca 0.24 -0.69 -0.06 0.00 1.00 0.00 0.00 64.86 65.35 2a5w h ILE 62 Cb 0.02 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2a5w h ILE 62 CO -0.04 0.30 -0.21 0.50 0.00 0.00 0.00 178.15 178.70 2a5w h LYS 63 N 1.20 0.17 -0.00 2.37 3.64 -0.88 -3.40 116.57 119.66 2a5w h LYS 63 Ca 0.29 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2a5w h LYS 63 Cb 0.09 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2a5w h LYS 63 CO -0.04 0.87 -0.48 0.66 -2.27 0.00 0.00 179.45 178.20 2a5w n TYR 64 N -4.54 0.00 -1.00 1.91 4.02 0.90 -5.00 117.16 113.45 2a5w n TYR 64 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.80 2a5w n TYR 64 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 2a5w n TYR 64 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2a5w n GLY 65 N 1.22 0.38 3.18 2.72 0.00 0.12 -5.00 105.19 107.82 2a5w n GLY 65 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 2a5w n GLY 65 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2a5w s VAL 66 N -1.79 0.07 0.32 1.61 -7.23 -1.26 -5.03 120.40 107.09 2a5w s VAL 66 Ca 0.00 -1.92 -0.16 0.00 -1.81 0.00 0.00 61.98 58.09 2a5w s VAL 66 Cb 0.00 -2.19 -0.09 0.00 0.56 0.00 0.00 36.38 34.66 2a5w s VAL 66 CO 0.00 -0.30 0.75 0.00 -0.31 0.00 0.00 175.10 175.24 2a5w s ALA 67 N -4.08 3.31 0.58 1.32 0.00 -0.55 -3.42 121.76 118.91 2a5w s ALA 67 Ca 0.29 0.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.14 2a5w s ALA 67 Cb 0.07 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.35 2a5w s ALA 67 CO 0.05 0.32 1.13 -1.25 0.00 0.00 0.00 175.76 176.01 2a5w s PRO 68 N -2.93 3.14 0.69 0.00 0.04 -1.26 -3.99 135.00 130.69 2a5w s PRO 68 Ca 0.54 1.56 -0.15 0.00 0.04 0.00 0.00 61.00 62.99 2a5w s PRO 68 Cb -0.11 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.47 2a5w s PRO 68 CO 0.17 -1.01 1.14 -1.25 0.04 0.00 0.00 177.00 176.09 2a5w s PRO 69 N -3.54 2.56 0.23 0.56 0.04 -1.24 -3.84 135.00 129.77 2a5w s PRO 69 Ca 0.71 1.50 -0.06 0.00 0.04 0.00 0.00 61.00 63.20 2a5w s PRO 69 Cb -0.23 -1.91 0.36 0.00 0.04 0.00 0.00 34.50 32.76 2a5w s PRO 69 CO 0.32 -1.46 1.79 0.28 0.04 0.00 0.00 177.00 177.97 2a5w h VAL 70 N -0.12 0.88 -0.84 -0.36 2.07 -1.60 -1.45 116.25 114.83 2a5w h VAL 70 Ca -0.47 -0.24 0.21 0.00 0.82 0.00 0.00 66.70 67.02 2a5w h VAL 70 Cb 1.26 0.13 -0.15 0.00 -1.52 0.00 0.00 31.29 31.01 2a5w h VAL 70 CO 0.52 0.13 0.03 -0.09 0.02 0.00 0.00 177.57 178.18 2a5w h ARG 71 N 0.69 0.09 -0.10 1.57 2.43 -1.91 0.04 114.38 117.18 2a5w h ARG 71 Ca 0.37 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 59.34 2a5w h ARG 71 Cb 0.36 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2a5w h ARG 71 CO -0.26 0.06 -0.72 1.98 -1.51 0.00 0.00 179.97 179.52 2a5w h MET 72 N 0.09 0.66 -0.42 0.20 4.05 -1.66 -2.97 114.93 114.89 2a5w h MET 72 Ca 0.48 -0.58 0.07 0.00 -0.28 0.00 0.00 59.70 59.39 2a5w h MET 72 Cb 0.90 0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.78 2a5w h MET 72 CO -0.75 1.20 0.07 1.25 0.23 0.00 0.00 176.91 178.91 2a5w h LEU 73 N 0.33 -0.01 -0.31 3.39 5.85 -0.44 -0.81 115.31 123.30 2a5w h LEU 73 Ca -0.06 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2a5w h LEU 73 Cb 1.37 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 2a5w h LEU 73 CO 0.15 0.03 0.15 0.58 -0.34 0.00 0.00 178.44 179.00 2a5w h VAL 74 N 0.20 1.16 -0.06 1.05 2.07 -1.09 -0.75 116.25 118.83 2a5w h VAL 74 Ca 0.20 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.29 2a5w h VAL 74 Cb 0.26 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2a5w h VAL 74 CO -0.28 0.17 -0.16 0.50 0.02 0.00 0.00 177.57 177.82 2a5w h LYS 75 N 0.37 -0.23 -0.69 1.57 3.64 -1.38 -0.43 116.57 119.41 2a5w h LYS 75 Ca 0.11 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.61 2a5w h LYS 75 Cb 0.13 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 31.93 2a5w h LYS 75 CO -0.01 -0.15 0.31 1.25 -2.27 0.00 0.00 179.45 178.57 2a5w h HIS 76 N -0.23 0.54 -0.47 1.91 2.76 -0.95 -2.37 115.15 116.35 2a5w h HIS 76 Ca 0.07 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 2a5w h HIS 76 Cb 0.34 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 2a5w h HIS 76 CO -0.24 0.16 0.14 0.00 -1.30 0.00 0.00 177.93 176.69 2a5w h LYS 78 N 0.62 1.02 0.21 0.00 1.57 -0.88 0.19 116.57 119.29 2a5w h LYS 78 Ca 0.15 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.56 2a5w h LYS 78 Cb 0.27 -0.23 0.03 0.00 0.08 0.00 0.00 32.23 32.38 2a5w h LYS 78 CO -0.00 0.67 -1.40 -0.22 -0.57 0.00 0.00 179.45 177.93 2a5w h LYS 79 N 1.05 0.43 0.00 3.15 3.64 -0.95 -3.22 116.57 120.68 2a5w h LYS 79 Ca 0.39 -0.74 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2a5w h LYS 79 Cb 0.17 0.28 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2a5w h LYS 79 CO -0.14 1.35 -1.04 0.39 -2.27 0.00 0.00 179.45 177.74 2a5w n GLU 80 N -3.80 1.73 -0.03 1.90 -0.58 0.10 -4.83 120.64 115.14 2a5w n GLU 80 Ca -0.19 -0.05 -0.03 0.00 -0.42 0.00 0.00 57.16 56.47 2a5w n GLU 80 Cb 1.02 -1.11 -0.01 0.00 -0.57 0.00 0.00 31.44 30.77 2a5w n GLU 80 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2a5w n VAL 81 N -1.59 0.64 -3.55 2.62 0.31 0.56 -5.02 118.33 112.29 2a5w n VAL 81 Ca -0.00 0.31 -0.16 0.00 -0.01 0.00 0.00 64.34 64.47 2a5w n VAL 81 Cb 0.21 -1.75 -0.06 0.00 -0.91 0.00 0.00 33.84 31.33 2a5w n VAL 81 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2a5w s ARG 82 N -1.76 0.95 0.59 5.55 1.70 -0.58 -5.04 118.95 120.36 2a5w s ARG 82 Ca -0.10 0.44 0.29 0.00 -0.47 0.00 0.00 55.73 55.88 2a5w s ARG 82 Cb 0.01 0.45 1.65 0.00 -0.57 0.00 0.00 34.95 36.50 2a5w s ARG 82 CO 0.15 -0.25 2.10 -1.35 -1.08 0.00 0.00 175.30 174.86 2a5w h PRO 83 N 3.48 0.00 -0.55 3.89 0.11 -1.81 -0.62 132.00 136.50 2a5w h PRO 83 Ca -0.27 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.80 2a5w h PRO 83 Cb 1.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2a5w h PRO 83 CO 0.29 0.00 0.05 -0.40 -0.21 0.00 0.00 178.00 177.73 2a5w n ASP 84 N -3.80 5.25 -4.26 -2.05 5.75 -1.26 -4.80 116.55 111.38 2a5w n ASP 84 Ca 0.02 -3.02 -0.43 0.00 -0.01 0.00 0.00 54.79 51.35 2a5w n ASP 84 Cb 0.33 -0.67 0.00 0.00 -1.03 0.00 0.00 41.12 39.75 2a5w n ASP 84 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2a5w n ASN 86 N 6.40 0.14 -0.33 0.00 0.23 -1.26 -4.03 115.26 116.42 2a5w n ASN 86 Ca 0.45 -1.43 -0.02 0.00 -0.53 0.00 0.00 54.58 53.05 2a5w n ASN 86 Cb 0.42 -0.81 0.14 0.00 -2.08 0.00 0.00 39.78 37.45 2a5w n ASN 86 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2a5w h LEU 87 N 0.00 1.07 -0.51 -4.53 5.85 -1.95 -0.86 115.31 114.38 2a5w h LEU 87 Ca -0.35 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.39 2a5w h LEU 87 Cb 0.97 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 2a5w h LEU 87 CO 0.25 0.79 0.21 -0.61 -0.34 0.00 0.00 178.44 178.75 2a5w h GLN 88 N 1.25 0.40 -0.49 1.25 4.15 -1.96 -0.61 115.11 119.10 2a5w h GLN 88 Ca 0.33 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.71 2a5w h GLN 88 Cb -0.11 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.47 2a5w h GLN 88 CO -0.07 0.27 0.25 -0.92 -1.93 0.00 0.00 178.83 176.43 2a5w h TYR 89 N 0.42 0.70 -0.81 3.99 3.20 -1.57 -0.62 116.97 122.26 2a5w h TYR 89 Ca 0.24 -0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.20 2a5w h TYR 89 Cb 0.22 -0.22 -0.08 0.00 1.54 0.00 0.00 36.73 38.19 2a5w h TYR 89 CO -0.14 0.54 0.43 0.82 -1.64 0.00 0.00 178.16 178.17 2a5w h ILE 90 N 0.65 0.82 0.00 1.81 2.04 -0.85 -1.49 117.51 120.49 2a5w h ILE 90 Ca 0.17 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 2a5w h ILE 90 Cb 0.09 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.24 2a5w h ILE 90 CO -0.02 0.12 -0.33 1.88 0.00 0.00 0.00 178.15 179.80 2a5w h TYR 91 N 0.68 0.00 -0.47 1.37 -1.99 -0.52 0.22 116.97 116.25 2a5w h TYR 91 Ca 0.42 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 61.12 2a5w h TYR 91 Cb 0.49 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.20 2a5w h TYR 91 CO -0.08 0.33 0.18 -0.22 -0.00 0.00 0.00 178.16 178.36 2a5w h LYS 92 N 0.00 0.71 -0.10 4.88 3.64 -0.17 -2.39 116.57 123.15 2a5w h LYS 92 Ca -0.00 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2a5w h LYS 92 Cb 0.72 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2a5w h LYS 92 CO 0.04 0.65 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.74 2a5w h LEU 93 N 0.62 0.23 -7.29 5.20 3.38 -1.04 -3.40 115.31 113.00 2a5w h LEU 93 Ca 0.16 -0.45 -0.63 0.00 0.09 0.00 0.00 57.88 57.05 2a5w h LEU 93 Cb 0.22 -0.06 -0.41 0.00 0.09 0.00 0.00 40.66 40.50 2a5w h LEU 93 CO -0.01 0.62 -0.64 -0.36 0.09 0.00 0.00 178.44 178.14 2a5w s PHE 94 N -4.43 3.03 0.50 1.13 0.40 0.74 -4.94 117.98 114.41 2a5w s PHE 94 Ca -0.15 -3.08 0.29 0.00 -0.60 0.00 0.00 56.93 53.39 2a5w s PHE 94 Cb 0.04 -2.66 1.39 0.00 0.51 0.00 0.00 43.02 42.29 2a5w s PHE 94 CO 0.72 -0.73 1.85 -1.35 0.70 0.00 0.00 175.22 176.41 2a5w h PRO 95 N 6.43 0.11 -0.02 0.24 0.11 -1.65 0.62 132.00 137.84 2a5w h PRO 95 Ca -0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2a5w h PRO 95 Cb 0.88 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2a5w h PRO 95 CO 0.66 0.07 -0.01 1.04 -0.21 0.00 0.00 178.00 179.55 2a5w n GLN 96 N -4.33 1.82 0.00 1.05 6.02 -1.26 -4.95 117.38 115.72 2a5w n GLN 96 Ca 0.21 -1.22 0.00 0.00 -0.01 0.00 0.00 57.00 55.98 2a5w n GLN 96 Cb 0.98 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.76 2a5w n GLN 96 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2a5w n GLY 97 N 1.23 1.00 0.20 1.08 0.00 0.22 -4.21 105.19 104.71 2a5w n GLY 97 Ca 0.17 -2.09 0.06 0.00 0.00 0.00 0.00 46.02 44.16 2a5w n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2a5w h PRO 98 N 0.00 0.00 0.00 1.61 0.13 -1.88 -1.79 132.00 130.07 2a5w h PRO 98 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 2a5w h PRO 98 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2a5w h PRO 98 CO 0.00 0.32 -0.41 0.00 -0.23 0.00 0.00 178.00 177.68 2a5w h ALA 99 N 1.68 0.04 -0.08 -0.56 0.00 -1.84 0.13 119.26 118.62 2a5w h ALA 99 Ca -0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.35 2a5w h ALA 99 Cb 0.72 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2a5w h ALA 99 CO 0.04 0.32 -0.37 0.87 0.00 0.00 0.00 179.25 180.11 2a5w h LYS 100 N -1.00 0.17 0.00 0.00 1.57 -1.73 -3.28 116.57 112.30 2a5w h LYS 100 Ca -0.06 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 2a5w h LYS 100 Cb 0.54 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2a5w h LYS 100 CO -0.04 0.52 -0.96 -0.25 -0.57 0.00 0.00 179.45 178.16 2a5w n ASP 101 N -4.07 1.65 -0.04 0.86 8.00 -0.70 -4.49 116.55 117.78 2a5w n ASP 101 Ca -0.01 0.27 -0.13 0.00 0.71 0.00 0.00 54.79 55.63 2a5w n ASP 101 Cb 0.44 -0.62 -0.08 0.00 -0.02 0.00 0.00 41.12 40.84 2a5w n ASP 101 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2a5w h ALA 102 N -0.71 0.14 -0.56 2.24 0.00 -1.32 0.05 119.26 119.09 2a5w h ALA 102 Ca -0.09 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 2a5w h ALA 102 Cb 0.84 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2a5w h ALA 102 CO -0.05 -0.06 0.06 0.00 0.00 0.00 0.00 179.25 179.19 2a5w h ARG 104 N 0.86 -0.74 -0.06 0.00 2.43 -1.57 -2.04 114.38 113.27 2a5w h ARG 104 Ca 0.17 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2a5w h ARG 104 Cb 0.42 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 2a5w h ARG 104 CO 0.01 -0.49 -0.17 0.82 -1.51 0.00 0.00 179.97 178.63 2a5w h ILE 105 N -0.76 1.16 0.00 1.20 2.04 -0.90 -0.82 117.51 119.42 2a5w h ILE 105 Ca -0.05 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.09 2a5w h ILE 105 Cb 0.64 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 2a5w h ILE 105 CO 0.03 0.21 0.00 0.00 0.00 0.00 0.00 178.15 178.40 2a5w n ALA 106 N -2.50 2.32 -1.26 1.87 0.00 -0.07 -4.43 120.51 116.44 2a5w n ALA 106 Ca -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.27 2a5w n ALA 106 Cb 0.26 -1.39 -0.00 0.00 0.00 0.00 0.00 19.45 18.32 2a5w n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a5w n GLY 107 N 0.60 0.45 3.76 0.00 0.00 -0.31 -4.73 105.19 104.95 2a5w n GLY 107 Ca 0.15 -0.98 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 2a5w n GLY 107 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a5w s LEU 108 N -0.34 4.51 0.43 0.99 1.02 -0.80 -4.63 118.68 119.86 2a5w s LEU 108 Ca 0.00 2.35 0.23 0.00 0.02 0.00 0.00 54.13 56.72 2a5w s LEU 108 Cb 0.00 -3.63 0.88 0.00 0.02 0.00 0.00 46.19 43.47 2a5w s LEU 108 CO 0.00 -0.27 1.82 1.55 0.02 0.00 0.00 176.35 179.47 2a5w h PRO 109 N 4.05 0.00 -3.54 1.29 0.13 -1.89 -3.34 132.00 128.71 2a5w h PRO 109 Ca -0.47 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 2a5w h PRO 109 Cb 1.21 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.16 2a5w h PRO 109 CO 0.68 0.26 -0.41 0.15 -0.23 0.00 0.00 178.00 178.45 2a5w s LYS 110 N -3.68 0.65 -0.00 0.86 -0.14 -1.26 -4.62 119.74 111.55 2a5w s LYS 110 Ca 0.00 -0.58 0.05 0.00 -1.36 0.00 0.00 55.97 54.09 2a5w s LYS 110 Cb 0.11 0.27 0.16 0.00 -1.68 0.00 0.00 37.83 36.68 2a5w s LYS 110 CO 0.65 -0.18 1.12 -0.35 -0.76 0.00 0.00 175.35 175.83 2a5w n PRO 111 N 0.85 1.42 -1.68 -1.68 -0.04 -1.26 -4.80 135.00 127.81 2a5w n PRO 111 Ca -0.20 -0.64 -0.45 0.00 -0.04 0.00 0.00 63.50 62.17 2a5w n PRO 111 Cb 0.58 -1.15 -0.04 0.00 -0.04 0.00 0.00 33.50 32.85 2a5w n PRO 111 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2a5w n THR 112 N 0.02 0.06 0.00 0.52 -1.04 -1.26 -1.42 114.28 111.16 2a5w n THR 112 Ca 0.06 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2a5w n THR 112 Cb 0.16 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 66.99 2a5w n THR 112 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2a5w n GLY 113 N 3.63 2.07 2.93 3.41 0.00 -1.26 -1.49 105.19 114.48 2a5w n GLY 113 Ca 0.17 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2a5w n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32